| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 18 | No |
Popular Name: 4-[[[(3R)-1,1-dioxothiolan-3-yl]methylamino]methyl]benzonitrile 4-[[[(3R)-1,1-dioxothiolan-3-yl]…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.15 | 4.33 | -76.52 | 2 | 4 | 1 | 75 | 265.358 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.15 | 3.02 | -15.83 | 1 | 4 | 0 | 70 | 264.35 | 4 | ↓ |
